1-[(4-bromanyl-1H-pyrrol-2-yl)carbonylamino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea

Systemtic Name: 1-[(4-bromanyl-1H-pyrrol-2-yl)carbonylamino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea Openeye Name: 1-[(4-bromo-1H-pyrrole-2-carbonyl)amino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea CAS Name: 1-[[(4-bromo-1H-pyrrol-2-yl)-oxomethyl]amino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea IUPAC Name: 1-[(4-bromo-1H-pyrrole-2-carbonyl)amino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea Traditional Name: 1-[(4-bromo-1H-pyrrole-2-carbonyl)amino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea Formula: C13H19BrN4OS MolecularWeight: 359.28516

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)NNC(=O)C2=CC(=CN2)Br

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=S)NNC(=O)C2=CC(=CN2)Br

InChI

InChI=1S/C13H19BrN4OS/c1-8-4-2-3-5-10(8)16-13(20)18-17-12(19)11-6-9(14)7-15-11/h6-8,10,15H,2-5H2,1H3,(H,17,19)(H2,16,18,20)/t8-,10-/m0/s1